Consensus flow list

Identity

Type
Chemical salt
CAS
140-93-2
EC
205-443-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Proxan-sodium

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string IRZFQKXEKAODTJ-UHFFFAOYSA-M, KBKAUGFMRGQXTO-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H8OS2.Na/c1-3(2)5-4(6)7;/h3H,1-2H3,(H,6,7);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Carbonic acid, dithio-, O-isopropyl ester, sodium salt
Molecular formula chemrof:molecular_formula C4H7NaOS2, C4H8NaOS2
SMILES string chemrof:smiles_string CC(C)OC(=S)[S-].[Na+]

Known URLs

2

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=140-93-2 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/24184720 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
68c6f628-50c6-41fb-b573-f909f27cb163 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
6e8a9eb6-129d-43c2-bfc6-e3bbb6a0b947 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
efddbb82-2209-455c-bc45-fcd70cd43107 Environmental → Air → Indoor EF 3.1 kg 4
ee502f5d-7047-42f1-8619-cfddc44d04d6 Environmental → Air → Long-term EF 3.1 kg 0
64f0004f-7355-4f8b-be37-0c3d6cd8bc2e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
65525c99-626d-4ef7-a493-10d6e9124678 Environmental → Air → Unknown EF 3.1 kg 4
86c4619c-f3e8-4ca4-8179-5069ac05ba41 Environmental → Ground → Agricultural EF 3.1 kg 4
53fa231f-4549-4e04-856e-886dfad0bb46 Environmental → Ground → Non-agricultural EF 3.1 kg 4
e5c7324d-4a10-4ee9-8a33-4e9294bc5a03 Environmental → Ground → Unknown EF 3.1 kg 4
66ca1a65-f029-4082-9452-fd5dbb1c48df Environmental → Water → Long-term EF 3.1 kg 0
cbad8bce-e561-46ed-b86b-0cbc7d8ea0cd Environmental → Water → Ocean EF 3.1 kg 4
d4040e46-5dd4-4239-81f7-691a83538d7c Environmental → Water → Surface water EF 3.1 kg 4
e20b9d17-76b9-4d6c-b391-86e1db598c3d Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-7ac87c46a3b652b8",
  "prefLabel": [
    {
      "@value": "Proxan-sodium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Accelerator SIP",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Carbonic acid, dithio-, O-isopropyl ester, sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Carbonodithioic acid, O-(1-methylethyl) ester, sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Carbonodithioic acid, O-(1-methylethyl) ester, sodium salt (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Good-rite Nix",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isopropylxanthic acid sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "O-Isopropyl sodium dithiocarbonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "O-Isopropyl sodium xanthate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium isopropyl xanthate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium isopropylxanthogenate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium O-isopropyl dithiocarbonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium O-isopropyl xanthate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:140-93-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C4H7NaOS2",
        "C4H8NaOS2"
      ],
      "attested_by": {
        "C4H8NaOS2": [
          "enrich_references.pubchem_semantic"
        ],
        "C4H7NaOS2": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:24184720"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)OC(=S)[S-].[Na+]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "IRZFQKXEKAODTJ-UHFFFAOYSA-M",
        "KBKAUGFMRGQXTO-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "KBKAUGFMRGQXTO-UHFFFAOYSA-N": [
          "enrich_references.pubchem_semantic"
        ],
        "IRZFQKXEKAODTJ-UHFFFAOYSA-M": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:24184720"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)OC(=S)[S-].[Na+]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "CC(C)OC(=S)[S-].[Na+]"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Carbonic acid, dithio-, O-isopropyl ester, sodium salt"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)OC(=S)[S-].[Na+]"
          ]
        }
      ],
      "attested_by": {
        "CC(C)OC(=S)[S-].[Na+]": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C4H8OS2.Na/c1-3(2)5-4(6)7;/h3H,1-2H3,(H,6,7);/q;+1/p-1"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Carbonic acid, dithio-, O-isopropyl ester, sodium salt"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC(C)OC(=S)[S-].[Na+]"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C4H8OS2.Na/c1-3(2)5-4(6)7;/h3H,1-2H3,(H,6,7);/q;+1/p-1": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Carbonic acid, dithio-, O-isopropyl ester, sodium salt"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Carbonic acid, dithio-, O-isopropyl ester, sodium salt"
        ]
      },
      "attested_by": {
        "Carbonic acid, dithio-, O-isopropyl ester, sodium salt": [
          "opsin_iupac"
        ]
      }
    }
  },
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=140-93-2",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:24184720;CAS:140-93-2"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[140-93-2]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/24184720",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:24184720;CAS:140-93-2"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[140-93-2]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "53fa231f-4549-4e04-856e-886dfad0bb46",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "multi_component_ionic",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/ChemicalSalt"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.multi_component_ionic"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "140-93-2"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=140-93-2"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "205-443-5"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=205-443-5"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/ChemicalSalt"
  ]
}

Keyboard

?
Show or hide this map
Esc
Close

More as the sections are built.